(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C9H7ClN4O4S MolecularWeight: 302.69428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=C(SN=N2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=C(SN=N2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H7ClN4O4S/c1-13-3-5(14(16)17)2-7(13)9(15)18-4-6-8(10)19-12-11-6/h2-3H,4H2,1H3